2786-4507 Screening compound: ethyl 2-[6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonyloxy]propanoate

2786-4507 Screening compound: ethyl 2-[6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonyloxy]propanoate
2786-4507 Screening compound: ethyl 2-[6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonyloxy]propanoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2786-4507
ethyl 2-[6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonyloxy]propanoate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2786-4507

Molecular Formula

C20H26N2O8 (C20 H26 N2 O8)

Compound Name

ethyl 2-[6-methyl-2-oxo-4-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonyloxy]propanoate

IUPAC name

ethyl 2-[6-methyl-2-oxo-4-(345-trimethoxyphenyl)-1234-tetrahydropyrimidine-5-carbonyloxy]propanoate

SMILES

CCOC(C(C)OC(C(C(c(cc1OC)cc(OC)c1OC)N1)=C(C)NC1=O)=O)=O

InChI

InChI=1S/C20H26N2O8/c1-7-29-18(23)11(3)30-19(24)15-10(2)21-20(25)22-16(15)12-8-13(26-4)17(28-6)14(9-12)27-5/h8-9,11,16H,7H2,1-6H3,(H2,21,22,25)

InChI Key

IGLAFJBTGWCMTC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01823640

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

422.44

Hydrogen Bond Acceptors Count

11.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.265

Distribution Coefficient, logD

1.175

Water Solubility, LogSw

-2.01

Polar Surface Area

99.842

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

-4.12

Number of Chiral Centers

2.00

Percent sp3 carbon bonding

45.00

References: we are preparing a list of scientific research reports with 2786-4507 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2786-4507?
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What is the minimum amount of 2786-4507 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2786-4507
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2786-4507
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2786-4507 available by request